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	hartrees
Energy at 0K	-573.225604
Energy at 298.15K	-573.226785
HF Energy	-572.780320
Nuclear repulsion energy	88.296622

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3161	2967	29.09
2	A'	1905	1788	317.00
3	A'	1420	1333	39.85
4	A'	793	744	201.79
5	A'	485	455	6.82
6	A"	981	921	1.54

Atom	x (Å)	y (Å)
C1	0.000	0.791
O2	1.133	1.149
Cl3	-0.482	-0.905
H4	-0.880	1.443

	C1	O2	Cl3	H4
C1		1.1886	1.7625	1.0953
O2	1.1886		2.6127	2.0346
Cl3	1.7625	2.6127		2.3813
H4	1.0953	2.0346	2.3813

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	Cl3	123.409		O2	C1	H4	125.902
Cl3	C1	H4	110.688

All results from a given calculation for COHCl (Formyl chloride)

using model chemistry: MP3/6-31G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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